N-(5-butylsulfanyl-1,3,4-thiadiazol-2-yl)-5-(methoxymethyl)-1-phenyl-1,2,3-triazole-4-carboxamide

Systemtic Name: N-(5-butylsulfanyl-1,3,4-thiadiazol-2-yl)-5-(methoxymethyl)-1-phenyl-1,2,3-triazole-4-carboxamide Openeye Name: N-(5-butylsulfanyl-1,3,4-thiadiazol-2-yl)-5-(methoxymethyl)-1-phenyl-triazole-4-carboxamide CAS Name: N-[5-(butylthio)-1,3,4-thiadiazol-2-yl]-5-(methoxymethyl)-1-phenyl-4-triazolecarboxamide IUPAC Name: N-(5-butylsulfanyl-1,3,4-thiadiazol-2-yl)-5-(methoxymethyl)-1-phenyltriazole-4-carboxamide Traditional Name: N-[5-(butylthio)-1,3,4-thiadiazol-2-yl]-5-(methoxymethyl)-1-phenyl-triazole-4-carboxamide Formula: C17H20N6O2S2 MolecularWeight: 404.5097

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NN=C(S1)NC(=O)C2=C(N(N=N2)C3=CC=CC=C3)COC

Isomeric SMILES

CCCCSC1=NN=C(S1)NC(=O)C2=C(N(N=N2)C3=CC=CC=C3)COC

InChI

InChI=1S/C17H20N6O2S2/c1-3-4-10-26-17-21-20-16(27-17)18-15(24)14-13(11-25-2)23(22-19-14)12-8-6-5-7-9-12/h5-9H,3-4,10-11H2,1-2H3,(H,18,20,24)